Mathematical Modeling Approaches for Optimization of Chemical Processes

Mathematical Modeling Approaches for Optimization of Chemical Processes
Author: Gabriela Corsano
Publisher:
Total Pages: 0
Release: 2009
Genre: Chemical processes
ISBN: 9781604569421

Mathematical modelling is a powerful tool for solving optimisation problems in chemical engineering. In this work several models are proposed aimed at helping to make decisions about different aspects of the processes lifecycle, from the synthesis and design steps up to the operation and scheduling. Using an example of the Sugar Cane industry, several models are formulated and solved in order to assess the trade-offs involved in optimisation decisions. Thus, the power and versatility of mathematical modelling in the area of chemical processes optimisation is analysed and evaluated.

Mathematical Modeling in Science and Engineering

Mathematical Modeling in Science and Engineering
Author: Ismael Herrera
Publisher: John Wiley & Sons
Total Pages: 259
Release: 2012-03-19
Genre: Technology & Engineering
ISBN: 1118207203

A powerful, unified approach to mathematical and computational modeling in science and engineering Mathematical and computational modeling makes it possible to predict the behavior of a broad range of systems across a broad range of disciplines. This text guides students and professionals through the axiomatic approach, a powerful method that will enable them to easily master the principle types of mathematical and computational models used in engineering and science. Readers will discover that this axiomatic approach not only enables them to systematically construct effective models, it also enables them to apply these models to any macroscopic physical system. Mathematical Modeling in Science and Engineering focuses on models in which the processes to be modeled are expressed as systems of partial differential equations. It begins with an introductory discussion of the axiomatic formulation of basic models, setting the foundation for further topics such as: Mechanics of classical and non-classical continuous systems Solute transport by a free fluid Flow of a fluid in a porous medium Multiphase systems Enhanced oil recovery Fluid mechanics Throughout the text, diagrams are provided to help readers visualize and better understand complex mathematical concepts. A set of exercises at the end of each chapter enables readers to put their new modeling skills into practice. There is also a bibliography in each chapter to facilitate further investigation of individual topics. Mathematical Modeling in Science and Engineering is ideal for both students and professionals across the many disciplines of science and engineering that depend on mathematical and computational modeling to predict and understand complex systems.

Mathematical Models and Methods for Ab Initio Quantum Chemistry

Mathematical Models and Methods for Ab Initio Quantum Chemistry
Author: M. Defranceschi
Publisher: Springer Science & Business Media
Total Pages: 247
Release: 2012-12-06
Genre: Science
ISBN: 3642572375

On the occasion of the fourth International Conference on Industrial and Applied Mathematics!, we decided to organize a sequence of 4 minisymposia devoted to the mathematical aspects and the numerical aspects of Quantum Chemistry. Our goal was to bring together scientists from different communities, namely mathematicians, experts at numerical analysis and computer science, chemists, just to see whether this heterogeneous set of lecturers can produce a rather homogeneous presentation of the domain to an uninitiated audience. To the best of our knowledgde, nothing of this kind had never been tempted so far. It seemed to us that it was the good time for doing it, both . because the interest of applied mathematicians into the world of computational chemistry has exponentially increased in the past few years, and because the community of chemists feels more and more concerned with the numerical issues. Indeed, in the early years of Quantum Chemistry, the pioneers (Coulson, Mac Weeny, just to quote two of them) used to solve fundamental equations modelling toy systems which could be simply numerically handled in view of their very limited size. The true difficulty arose with the need to model larger systems while possibly taking into account their interaction with their environment. Hand calculations were no longer possible, and computing science came into the picture.

Linear Mathematical Models In Chemical Engineering

Linear Mathematical Models In Chemical Engineering
Author: Martin Aksel Hjortso
Publisher: World Scientific Publishing Company
Total Pages: 524
Release: 2010-01-15
Genre: Technology & Engineering
ISBN: 9813107138

Latest Edition: Linear Mathematical Models in Chemical Engineering (2nd Edition)Understanding the mathematical modeling of chemical processes is fundamental to the successful career of a researcher in chemical engineering. This book reviews, introduces, and develops the mathematics that is most frequently encountered in sophisticated chemical engineering models.The result of a collaboration between a chemical engineer and a mathematician, both of whom have taught classes on modeling and applied mathematics, the book provides a rigorous and in-depth coverage of chemical engineering model formulation and analysis as well as a text which can serve as an excellent introduction to linear mathematics for engineering students. There is a clear focus in the choice of material, worked examples, and exercises that make it unusually accessible to the target audience. The book places a heavy emphasis on applications to motivate the theory, but simultaneously maintains a high standard of rigor to add mathematical depth and understanding.

Mathematical Modeling in Chemical Engineering

Mathematical Modeling in Chemical Engineering
Author: Anders Rasmuson
Publisher: Cambridge University Press
Total Pages: 195
Release: 2014-03-20
Genre: Technology & Engineering
ISBN: 1107049695

A solid introduction, enabling the reader to successfully formulate, construct, simplify, evaluate and use mathematical models in chemical engineering.

Modeling of Atmospheric Chemistry

Modeling of Atmospheric Chemistry
Author: Guy P. Brasseur
Publisher: Cambridge University Press
Total Pages: 631
Release: 2017-06-19
Genre: Science
ISBN: 1108210953

Mathematical modeling of atmospheric composition is a formidable scientific and computational challenge. This comprehensive presentation of the modeling methods used in atmospheric chemistry focuses on both theory and practice, from the fundamental principles behind models, through to their applications in interpreting observations. An encyclopaedic coverage of methods used in atmospheric modeling, including their advantages and disadvantages, makes this a one-stop resource with a large scope. Particular emphasis is given to the mathematical formulation of chemical, radiative, and aerosol processes; advection and turbulent transport; emission and deposition processes; as well as major chapters on model evaluation and inverse modeling. The modeling of atmospheric chemistry is an intrinsically interdisciplinary endeavour, bringing together meteorology, radiative transfer, physical chemistry and biogeochemistry, making the book of value to a broad readership. Introductory chapters and a review of the relevant mathematics make this book instantly accessible to graduate students and researchers in the atmospheric sciences.

Mathematical Modeling and Numerical Methods in Chemical Physics and Mechanics

Mathematical Modeling and Numerical Methods in Chemical Physics and Mechanics
Author: Ali V. Aliev
Publisher: CRC Press
Total Pages: 564
Release: 2016-04-27
Genre: Mathematics
ISBN: 1771882905

The use of mathematical modeling in engineering allows for a significant reduction of material costs associated with design, production, and operation of technical objects, but it is important for an engineer to use the available computational approaches in modeling correctly. Taking into account the level of modern computer technology, this new vo

Chemical Reactor Design

Chemical Reactor Design
Author: Juan A. Conesa
Publisher: John Wiley & Sons
Total Pages: 350
Release: 2019-12-04
Genre: Science
ISBN: 3527346309

A guide to the technical and calculation problems of chemical reactor analysis, scale-up, catalytic and biochemical reactor design Chemical Reactor Design offers a guide to the myriad aspects of reactor design including the use of numerical methods for solving engineering problems. The author - a noted expert on the topic - explores the use of transfer functions to study residence time distributions, convolution and deconvolution curves for reactor characterization, forced-unsteady-state-operation, scale-up of chemical reactors, industrial catalysis, design of multiphasic reactors, biochemical reactors design, as well as the design of multiphase gas-liquid-solid reactors. Chemical Reactor Design contains several examples of calculations and it gives special emphasis on the numerical solutions of differential equations by using the finite differences approximation, which offers the background information for understanding other more complex methods. The book is designed for the chemical engineering academic community and includes case studies on mathematical modeling by using of MatLab software. This important book: - Offers an up-to-date insight into the most important developments in the field of chemical, catalytic, and biochemical reactor engineering - Contains new aspects such as the use of numerical methods for solving engineering problems, transfer functions to study residence time distributions, and more - Includes illustrative case studies on MatLab approach, with emphasis on numerical solution of differential equations using the finite differences approximation Written for chemical engineers, mechanical engineers, chemists in industry, complex chemists, bioengineers, and process engineers, Chemical Reactor Design addresses the technical and calculation problems of chemical reactor analysis, scale-up, as well as catalytic and biochemical reactor design.